N-[3-[(3S)-3-[(3,4-dimethylphenyl)amino]piperidin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: N-[3-[(3S)-3-[(3,4-dimethylphenyl)amino]piperidin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[3-[[(3S)-3-(3,4-dimethylanilino)-1-piperidyl]sulfonyl]phenyl]acetamide CAS Name: N-[3-[[(3S)-3-(3,4-dimethylanilino)-1-piperidinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[3-[(3S)-3-(3,4-dimethylanilino)piperidin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[3-[(3S)-3-(3,4-dimethylanilino)piperidino]sulfonylphenyl]acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CCCN(C2)S(=O)(=O)C3=CC=CC(=C3)NC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC(=C3)NC(=O)C)C

InChI

InChI=1S/C21H27N3O3S/c1-15-9-10-19(12-16(15)2)23-20-7-5-11-24(14-20)28(26,27)21-8-4-6-18(13-21)22-17(3)25/h4,6,8-10,12-13,20,23H,5,7,11,14H2,1-3H3,(H,22,25)/t20-/m0/s1